1,2-dimethyl-N-[4-(trifluoromethyl)cyclohexyl]piperidin-4-amine

C14H25F3N2 — CID 81297390

IUPAC1,2-dimethyl-N-[4-(trifluoromethyl)cyclohexyl]piperidin-4-amine
SMILESCC1CC(NC2CCC(C(F)(F)F)CC2)CCN1C
InChIInChI=1S/C14H25F3N2/c1-10-9-13(7-8-19(10)2)18-12-5-3-11(4-6-12)14(15,16)17/h10-13,18H,3-9H2,1-2H3
InChIKeyMAGUPCKKMXSEIQ-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.18
Rot. Bonds2

About 1,2-dimethyl-N-[4-(trifluoromethyl)cyclohexyl]piperidin-4-amine

1,2-dimethyl-N-[4-(trifluoromethyl)cyclohexyl]piperidin-4-amine (PubChem CID 81297390) has the molecular formula C14H25F3N2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 1,2-dimethyl-N-[4-(trifluoromethyl)cyclohexyl]piperidin-4-amine.

Molecular Properties

Compound Name1,2-dimethyl-N-[4-(trifluoromethyl)cyclohexyl]piperidin-4-amine
PubChem CID81297390
Molecular FormulaC14H25F3N2
Molecular Weight278.36 g/mol
Exact Mass278.20
IUPAC Name1,2-dimethyl-N-[4-(trifluoromethyl)cyclohexyl]piperidin-4-amine
SMILESCC1CC(NC2CCC(C(F)(F)F)CC2)CCN1C
InChIInChI=1S/C14H25F3N2/c1-10-9-13(7-8-19(10)2)18-12-5-3-11(4-6-12)14(15,16)17/h10-13,18H,3-9H2,1-2H3
InChIKeyMAGUPCKKMXSEIQ-UHFFFAOYSA-N
XLogP3.18
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-N-[4-(trifluoromethyl)cyclohexyl]piperidin-4-amine?
The IUPAC name of 1,2-dimethyl-N-[4-(trifluoromethyl)cyclohexyl]piperidin-4-amine (CID 81297390) is 1,2-dimethyl-N-[4-(trifluoromethyl)cyclohexyl]piperidin-4-amine.
What is the SMILES notation for 1,2-dimethyl-N-[4-(trifluoromethyl)cyclohexyl]piperidin-4-amine?
The canonical SMILES for 1,2-dimethyl-N-[4-(trifluoromethyl)cyclohexyl]piperidin-4-amine is CC1CC(NC2CCC(C(F)(F)F)CC2)CCN1C.
What is the InChIKey of 1,2-dimethyl-N-[4-(trifluoromethyl)cyclohexyl]piperidin-4-amine?
The InChIKey is MAGUPCKKMXSEIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F3N2/c1-10-9-13(7-8-19(10)2)18-12-5-3-11(4-6-12)14(15,16)17/h10-13,18H,3-9H2,1-2H3.
What are the key properties of 1,2-dimethyl-N-[4-(trifluoromethyl)cyclohexyl]piperidin-4-amine?
1,2-dimethyl-N-[4-(trifluoromethyl)cyclohexyl]piperidin-4-amine has a molecular weight of 278.36 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-N-[4-(trifluoromethyl)cyclohexyl]piperidin-4-amine is sourced from PubChem (CID 81297390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).